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6-Nitroindole

6-Nitroindole structure

CAS No:
4769-96-4
Formula:
C8H6N2O2
Chemical Name:
6-Nitroindole
Synonyms:
1H-Indole,6-nitro-;Indole,6-nitro-;6-Nitro-1H-indole;6-Nitroindole;NSC 89285
Categories:
Organic Chemistry > Heterocyclic Ring

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Description

yellow to brown-yellow powder

6-Nitroindole Basic Attributes

Molecular Weight：

162.15

Exact Mass：

162.15

EC Number：

225-311-0

NSC Number：

89285

DSSTox ID：

DTXSID00197242

HScode：

2933990090

Characteristics

PSA：

61.6

XLogP3：

2.5

Appearance：

Yellow crystalline powder

Density：

1.4±0.1 g/cm3

Melting Point：

139-140.5 °C

Boiling Point：

362.6°C at 760 mmHg

Flash Point：

173.1±20.4 °C

Refractive Index：

1.723

Safety Information

hazard class code：

R68

safety instructions：

S45-S36/37

Marks：

Xn:Harmful;

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (97.67%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 43 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:162.15
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:162.042927438
Monoisotopic Mass:162.042927438
Topological Polar Surface Area:61.6
Heavy Atom Count:12
Complexity:190
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 4769-96-4

Grade: Industrial Grade

Content: 99%

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CAS No.: 4769-96-4

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